2011
Energy Research: Computational Challenges
Batista V. Energy Research: Computational Challenges. 2011 DOI: 10.1002/9781119951438.eibc0461.Peer-Reviewed Original ResearchElectron transferEarth abundant transition metal complexesTransition metal complexesInterfacial electron transferNovel photocatalytic materialsVisible light absorptionNanoporous TiO2 thin filmsMetal complexesManganese catalystsPhotocatalytic materialsPhotocatalytic mechanismTiO2 thin filmsLight absorptionSolar cellsRecent computational workSemiconductor materialsFuel productionThin filmsRenewable resourcesElectrochemistryOverall efficiencyCatalystSpectroscopyComputational workRecent advances
2008
Acetylacetonate Anchors for Robust Functionalization of TiO2 Nanoparticles with Mn(II)−Terpyridine Complexes
McNamara WR, Snoeberger RC, Li G, Schleicher JM, Cady CW, Poyatos M, Schmuttenmaer CA, Crabtree RH, Brudvig GW, Batista VS. Acetylacetonate Anchors for Robust Functionalization of TiO2 Nanoparticles with Mn(II)−Terpyridine Complexes. Journal Of The American Chemical Society 2008, 130: 14329-14338. PMID: 18831585, DOI: 10.1021/ja805498w.Peer-Reviewed Original ResearchMeSH KeywordsComputer SimulationElectron Spin Resonance SpectroscopyElectronsHydroxybutyratesLightManganeseMembranes, ArtificialModels, ChemicalModels, MolecularMolecular StructureNanoparticlesOrganometallic CompoundsOxidation-ReductionParticle SizePentanonesPhotochemistryPorosityPyridinesSensitivity and SpecificitySpectrophotometry, UltravioletSurface PropertiesTime FactorsTitaniumWaterConceptsInterfacial electron injectionTiO2 nanoparticlesRobust functionalizationTransition metal ionsVisible light sensitizationElectron injectionInterfacial electron transferColloidal thin filmsTerpy complexesPhotocatalytic complexesOxidation chemistryEffective catalystCoupling reactionElectron transferNanoparticlesVariety of scaffoldsComplex of caPhotovoltaic devicesFunctionalizationSubpicosecond time scaleAqueous suspensionOxidative conditionsThin filmsComplexesTransient measurements
2007
Ultrafast Photooxidation of Mn(II)−Terpyridine Complexes Covalently Attached to TiO2 Nanoparticles
Abuabara S, Cady C, Baxter J, Schmuttenmaer C, Crabtree R, Brudvig G, Batista V. Ultrafast Photooxidation of Mn(II)−Terpyridine Complexes Covalently Attached to TiO2 Nanoparticles. The Journal Of Physical Chemistry C 2007, 111: 11982-11990. DOI: 10.1021/jp072380h.Peer-Reviewed Original ResearchInterfacial electron transferTiO2 nanoparticlesColloidal thin filmsVisible light sensitizationElectron transferTime-resolved measurementsSurface modificationNanoparticlesThin filmsTiO2 surfaceAqueous suspensionTransient measurementsEPR signalPhotoexcitationMeasurementsComputational simulationsFilmsFSSpectroscopyComplexesPhotooxidationTransferSurfaceSignals
2005
Energy Research: Computational Challenges
Batista V. Energy Research: Computational Challenges. 2005 DOI: 10.1002/0470862106.ia812.Peer-Reviewed Original ResearchElectron transferEarth abundant transition metal complexesTransition metal complexesInterfacial electron transferNovel photocatalytic materialsVisible light absorptionNanoporous TiO2 thin filmsMetal complexesManganese catalystsPhotocatalytic materialsPhotocatalytic mechanismTiO2 thin filmsLight absorptionSolar cellsRecent computational workSemiconductor materialsFuel productionThin filmsRenewable resourcesElectrochemistryOverall efficiencyCatalystSpectroscopyComputational workRecent advances